N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide

C4H6N4OS — CID 6483821

IUPACN-(5-amino-1,2,4-thiadiazol-3-yl)acetamide
SMILESCC(=O)Nc1nsc(N)n1
InChIInChI=1S/C4H6N4OS/c1-2(9)6-4-7-3(5)10-8-4/h1H3,(H3,5,6,7,8,9)
InChIKeySOXWDJNFKFONRS-UHFFFAOYSA-N
MW158.19 g/mol
LogP0.08
Rot. Bonds1

About N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide

N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide (PubChem CID 6483821) has the molecular formula C4H6N4OS and a molecular weight of 158.19 g/mol. Its IUPAC name is N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-amino-1,2,4-thiadiazol-3-yl)acetamide
PubChem CID6483821
Molecular FormulaC4H6N4OS
Molecular Weight158.19 g/mol
Exact Mass158.03
IUPAC NameN-(5-amino-1,2,4-thiadiazol-3-yl)acetamide
SMILESCC(=O)Nc1nsc(N)n1
InChIInChI=1S/C4H6N4OS/c1-2(9)6-4-7-3(5)10-8-4/h1H3,(H3,5,6,7,8,9)
InChIKeySOXWDJNFKFONRS-UHFFFAOYSA-N
XLogP0.08
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.19
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide?
The IUPAC name of N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide (CID 6483821) is N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide.
What is the SMILES notation for N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide?
The canonical SMILES for N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide is CC(=O)Nc1nsc(N)n1.
What is the InChIKey of N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide?
The InChIKey is SOXWDJNFKFONRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N4OS/c1-2(9)6-4-7-3(5)10-8-4/h1H3,(H3,5,6,7,8,9).
What are the key properties of N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide?
N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide has a molecular weight of 158.19 g/mol, XLogP of 0.08, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-1,2,4-thiadiazol-3-yl)acetamide is sourced from PubChem (CID 6483821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).